![3-[Bis(2-chloroethyl)hydrazinylidene]butan-2-one structure](/static/products/9462/94629-31-9.webp)
3-[Bis(2-chloroethyl)hydrazinylidene]butan-2-one
TL;DR: 3-[Bis(2-chloroethyl)hydrazinylidene]butan-2-one (CAS 94629-31-9) is a chemical compound with molecular formula C8H14Cl2N2O and molecular weight 224.04832 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-[bis(2-chloroethyl)hydrazinylidene]butan-2-one
Also Known As: (3E)-3-[bis(2-chloroethyl)hydrazinylidene]butan-2-one
Technical Specifications
| Molecular Formula | C8H14Cl2N2O |
| Molecular Weight | 224.04832 g/mol |
| XLogP | 1.5 |
| Topological Polar Surface Area (TPSA) | 32.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 224.04832 Da |
| Heavy Atoms | 13 |
| Complexity | 189.0 |
| SMILES | CC(=NN(CCCl)CCCl)C(=O)C |
| InChIKey | JBIWWYHSKWNCML-UHFFFAOYSA-N |
Chemical Property Profile of 3-[Bis(2-chloroethyl)hydrazinylidene]butan-2-one
Property Insights of 3-[Bis(2-chloroethyl)hydrazinylidene]butan-2-one
The XLogP value of 1.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-[Bis(2-chloroethyl)hydrazinylidene]butan-2-one. With a topological polar surface area (TPSA) of 32.7 Ų, 3-[Bis(2-chloroethyl)hydrazinylidene]butan-2-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-[Bis(2-chloroethyl)hydrazinylidene]butan-2-one has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 3-[Bis(2-chloroethyl)hydrazinylidene]butan-2-one?
The CAS number of 3-[Bis(2-chloroethyl)hydrazinylidene]butan-2-one is 94629-31-9.
What is the molecular formula of 3-[Bis(2-chloroethyl)hydrazinylidene]butan-2-one?
The molecular formula of 3-[Bis(2-chloroethyl)hydrazinylidene]butan-2-one is C8H14Cl2N2O.
What is the molecular weight of 3-[Bis(2-chloroethyl)hydrazinylidene]butan-2-one?
The molecular weight of 3-[Bis(2-chloroethyl)hydrazinylidene]butan-2-one is 224.04832 g/mol.
Where can I buy 3-[Bis(2-chloroethyl)hydrazinylidene]butan-2-one?
You can request a quote for 3-[Bis(2-chloroethyl)hydrazinylidene]butan-2-one directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 3-[Bis(2-chloroethyl)hydrazinylidene]butan-2-one?
Yes, CoreyChem provides custom synthesis services for 3-[Bis(2-chloroethyl)hydrazinylidene]butan-2-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.